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BDBM50216993 CHEMBL101418

SMILES: Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2nc(N)sc2c1

InChI Key: InChIKey=YFEIJKDAJRFHSE-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50216993   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50216993
PNG
(CHEMBL101418)
Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2nc(N)sc2c1
Show InChI InChI=1S/C23H24N6O2S/c1-15-12-27-21(25-10-9-16-5-3-2-4-6-16)22(31)29(15)14-20(30)26-13-17-7-8-18-19(11-17)32-23(24)28-18/h2-8,11-12H,9-10,13-14H2,1H3,(H2,24,28)(H,25,27)(H,26,30)
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PubMed
>3.97E+3n/an/an/an/an/an/an/an/a



Corvas International, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate

Bioorg Med Chem Lett 12: 2925-30 (2002)


BindingDB Entry DOI: 10.7270/Q27946WJ
More data for this
Ligand-Target Pair